SCHEMBL23724070

SCHEMBL23724070

CC1CCN(COc2ccc(N)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SIGMAR1 Q99720 5/20 0.50
KDM4E B2RXH2 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
RECQL P46063 1/20 0.49
HRH3 Q9Y5N1 7/20 0.48
TSHR P16473 2/20 0.46
MAOB P27338 1/20 0.45
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
CHRNA7 P36544 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23742203 0.85 MEN1 (0.53) MEN1KMT2ASIGMAR1KDM4ETDP1
SCHEMBL3866360 0.84 SIGMAR1 (0.71) KMT2ASIGMAR1KDM4ETDP1RECQL
SCHEMBL21695104 0.83 HRH3 (0.57) MEN1KMT2ASIGMAR1KDM4ETDP1
Hydrochloric Acid SCHEMBL3859180 0.83 SIGMAR1 (0.74) KMT2ASIGMAR1KDM4ETDP1RECQL
SCHEMBL23742241 0.81 MEN1 (0.49) MEN1KMT2ASIGMAR1KDM4ETDP1
SCHEMBL21814266 0.77 SIGMAR1 (0.62) SIGMAR1KDM4ETDP1RECQLHRH3
SCHEMBL14100110 0.76 ESR1 (0.49) SIGMAR1TDP1HRH3TSHR
SCHEMBL23475002 0.75 HRH3 (0.47) MEN1KMT2ASIGMAR1KDM4ETDP1
SCHEMBL23474913 0.75 HRH3 (0.47) MEN1KMT2ASIGMAR1KDM4ETDP1
SCHEMBL23474957 0.75 HRH3 (0.47) MEN1KMT2ASIGMAR1KDM4ETDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246920-A1 TRIAZOLE DERIVATIVES WITH ANTIFUNGAL ACTIVITY KING'S COLLEGE LONDON (GB) 2024-07-25 US disclosed
EP-4100400-A1 TRIAZOLE DERIVATIVES WITH ANTIFUNGAL ACTIVITY Kings College London (GB) 2022-12-14 EP disclosed
WO-2021156636-A1 TRIAZOLE DERIVATIVES WITH ANTIFUNGAL ACTIVITY KING'S COLLEGE LONDON (GB) 2021-08-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240246920-A1 TRIAZOLE DERIVATIVES WITH ANTIFUNGAL ACTIVITY RIF1, NAT1, POLR1C MEN1 342/4885KMT2A 3282/4885SIGMAR1 1777/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.